[4-[2-[9-(5-methoxyindol-1-yl)nonoxy]-2-oxidanylidene-ethyl]phenyl]-trimethyl-azanium iodide

Systemtic Name: [4-[2-[9-(5-methoxyindol-1-yl)nonoxy]-2-oxidanylidene-ethyl]phenyl]-trimethyl-azanium iodide Openeye Name: [4-[2-[9-(5-methoxyindol-1-yl)nonoxy]-2-oxo-ethyl]phenyl]-trimethyl-ammonium iodide CAS Name: [4-[2-[9-(5-methoxy-1-indolyl)nonoxy]-2-oxoethyl]phenyl]-trimethylammonium iodide IUPAC Name: [4-[2-[9-(5-methoxyindol-1-yl)nonoxy]-2-oxoethyl]phenyl]-trimethylazanium iodide Traditional Name: [4-[2-keto-2-[9-(5-methoxyindol-1-yl)nonoxy]ethyl]phenyl]-trimethyl-ammonium iodide Formula: C29H41IN2O3 MolecularWeight: 592.55191

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)C1=CC=C(C=C1)CC(=O)OCCCCCCCCCN2C=CC3=C2C=CC(=C3)OC.[I-]

Isomeric SMILES

C[N+](C)(C)C1=CC=C(C=C1)CC(=O)OCCCCCCCCCN2C=CC3=C2C=CC(=C3)OC.[I-]

InChI

InChI=1S/C29H41N2O3.HI/c1-31(2,3)26-14-12-24(13-15-26)22-29(32)34-21-11-9-7-5-6-8-10-19-30-20-18-25-23-27(33-4)16-17-28(25)30;/h12-18,20,23H,5-11,19,21-22H2,1-4H3;1H/q+1;/p-1